Dataset

fast-atom bombardment mass spectrometry (FABMS)

dataset for fast-atom bombardment mass spectrometry (FABMS)

Chemical Information

molecular Image
InChI InChI=1S/C33H28N2O2/c1-21-17-22(2)29-20-31(27-13-15-28(16-14-27)35(36)37)33(34-32(29)18-21)30-19-25-8-7-23-3-5-24(6-4-23)9-11-26(30)12-10-25/h3-6,10,12-20H,7-9,11H2,1-2H3
SMILES Cc1cc(C)c2c(c1)nc(c(c2)c1ccc(cc1)[N+](=O)[O-])c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key RCTOFKKNQOEIDV-UHFFFAOYSA-N
Molecular Formula C33H28N2O2
Exact Mass 484.588 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RCTOFKKNQOEIDV-UHFFFAOYSA-N/CHMO0000563
License URL
Source https://www.chemotion-repository.net/inchikey/RCTOFKKNQOEIDV-UHFFFAOYSA-N/CHMO0000563
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-05-21
Related Molecule
  • 5,7-dimethyl-3-(4-nitrophenyl)-2-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)quinoline
    • Field Value
    Measurement Technique fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.